Cas no 88932-13-2 (9H-Pyrido[3,4-b]indole-3-carboxamide)

9H-Pyrido[3,4-b]indole-3-carboxamide structure
88932-13-2 structure
Product Name:9H-Pyrido[3,4-b]indole-3-carboxamide
CAS No:88932-13-2
MF:C12H9N3O
MW:211.219362020493
CID:619472
PubChem ID:13129465
Update Time:2025-04-19

9H-Pyrido[3,4-b]indole-3-carboxamide Chemical and Physical Properties

Names and Identifiers

    • 9H-Pyrido[3,4-b]indole-3-carboxamide
    • beta-carbolin-3-carboxamide
    • DTXSID00520556
    • 88932-13-2
    • 9H-beta-Carboline-3-carboxamide
    • beta-carboline-3-carboxamide
    • SCHEMBL966651
    • YIZNPYBICIOFLG-UHFFFAOYSA-N
    • CHEMBL346218
    • Inchi: 1S/C12H9N3O/c13-12(16)10-5-8-7-3-1-2-4-9(7)15-11(8)6-14-10/h1-6,15H,(H2,13,16)
    • InChI Key: YIZNPYBICIOFLG-UHFFFAOYSA-N
    • SMILES: O=C(C1=CC2=C(C=N1)NC1C=CC=CC2=1)N

Computed Properties

  • Exact Mass: 211.074561919g/mol
  • Monoisotopic Mass: 211.074561919g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 294
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.4
  • Topological Polar Surface Area: 71.8?2
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